1-[[3-nitro-4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]phenyl]methyl]piperidin-4-ol

Systemtic Name: 1-[[3-nitro-4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]phenyl]methyl]piperidin-4-ol Openeye Name: 1-[[3-nitro-4-[4-(pyrrolidin-1-ylmethyl)-1-piperidyl]phenyl]methyl]piperidin-4-ol CAS Name: 1-[[3-nitro-4-[4-(1-pyrrolidinylmethyl)-1-piperidinyl]phenyl]methyl]-4-piperidinol IUPAC Name: 1-[[3-nitro-4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]phenyl]methyl]piperidin-4-ol Traditional Name: 1-[3-nitro-4-[4-(pyrrolidinomethyl)piperidino]benzyl]piperidin-4-ol Formula: C22H34N4O3 MolecularWeight: 402.53036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2CCN(CC2)C3=C(C=C(C=C3)CN4CCC(CC4)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CC2CCN(CC2)C3=C(C=C(C=C3)CN4CCC(CC4)O)[N+](=O)[O-]

InChI

InChI=1S/C22H34N4O3/c27-20-7-11-24(12-8-20)17-19-3-4-21(22(15-19)26(28)29)25-13-5-18(6-14-25)16-23-9-1-2-10-23/h3-4,15,18,20,27H,1-2,5-14,16-17H2